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BDBM65501 8-pCP-cGMP::Cyclic GMP analogs::cGMP

SMILES: Nc1nc(=O)c2nc(Sc3ccc(Cl)cc3)n([C@@H]3O[C@@H]4COP(O)(=O)O[C@H]4[C@H]3O)c2[nH]1

InChI Key: InChIKey=ZDJHIEHUVPCEDK-IDTAVKCVSA-N

Data: 16 EC50

Find this compound or compounds like it in BindingDB or PDB:
   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 16 hits for monomerid = 65501   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kcal/mole
IC50
nM
Kd
nM
EC50/IC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
hPKG 1 beta 1-351


(Homo sapiens (Human))
BDBM65501
PNG
(8-pCP-cGMP | Cyclic GMP analogs | cGMP)
Show SMILES Nc1nc(=O)c2nc(Sc3ccc(Cl)cc3)n([C@@H]3O[C@@H]4COP(O)(=O)O[C@H]4[C@H]3O)c2[nH]1
Show InChI InChI=1S/C16H15ClN5O7PS/c17-6-1-3-7(4-2-6)31-16-19-9-12(20-15(18)21-13(9)24)22(16)14-10(23)11-8(28-14)5-27-30(25,26)29-11/h1-4,8,10-11,14,23H,5H2,(H,25,26)(H3,18,20,21,24)/t8-,10-,11-,14-/m1/s1
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n/an/an/an/a 163n/an/an/an/a



Baylor College of Medicine



Assay Description
Kinase activity was determined employing a microfluidic mobility-shift assay on a Caliper DeskTop Profiler (Caliper Life Sciences, PerkinElmer). The ...


ACS Chem Biol 12: 2388-2398 (2017)


Article DOI: 10.1021/acschembio.7b00369
BindingDB Entry DOI: 10.7270/Q2930RB1
More data for this
Ligand-Target Pair
hPKG 1 beta 1-351 (G182E)


(Homo sapiens (Human))
BDBM65501
PNG
(8-pCP-cGMP | Cyclic GMP analogs | cGMP)
Show SMILES Nc1nc(=O)c2nc(Sc3ccc(Cl)cc3)n([C@@H]3O[C@@H]4COP(O)(=O)O[C@H]4[C@H]3O)c2[nH]1
Show InChI InChI=1S/C16H15ClN5O7PS/c17-6-1-3-7(4-2-6)31-16-19-9-12(20-15(18)21-13(9)24)22(16)14-10(23)11-8(28-14)5-27-30(25,26)29-11/h1-4,8,10-11,14,23H,5H2,(H,25,26)(H3,18,20,21,24)/t8-,10-,11-,14-/m1/s1
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Baylor College of Medicine



Assay Description
Kinase activity was determined employing a microfluidic mobility-shift assay on a Caliper DeskTop Profiler (Caliper Life Sciences, PerkinElmer). The ...


ACS Chem Biol 12: 2388-2398 (2017)


Article DOI: 10.1021/acschembio.7b00369
BindingDB Entry DOI: 10.7270/Q2930RB1
More data for this
Ligand-Target Pair
hPKG 1 beta 1-351 (G306E)


(Homo sapiens (Human))
BDBM65501
PNG
(8-pCP-cGMP | Cyclic GMP analogs | cGMP)
Show SMILES Nc1nc(=O)c2nc(Sc3ccc(Cl)cc3)n([C@@H]3O[C@@H]4COP(O)(=O)O[C@H]4[C@H]3O)c2[nH]1
Show InChI InChI=1S/C16H15ClN5O7PS/c17-6-1-3-7(4-2-6)31-16-19-9-12(20-15(18)21-13(9)24)22(16)14-10(23)11-8(28-14)5-27-30(25,26)29-11/h1-4,8,10-11,14,23H,5H2,(H,25,26)(H3,18,20,21,24)/t8-,10-,11-,14-/m1/s1
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n/an/an/an/a 4.20n/an/an/an/a



Baylor College of Medicine



Assay Description
Kinase activity was determined employing a microfluidic mobility-shift assay on a Caliper DeskTop Profiler (Caliper Life Sciences, PerkinElmer). The ...


ACS Chem Biol 12: 2388-2398 (2017)


Article DOI: 10.1021/acschembio.7b00369
BindingDB Entry DOI: 10.7270/Q2930RB1
More data for this
Ligand-Target Pair
hPKG 1 beta 1-351 (G306E)


(Homo sapiens (Human))
BDBM65501
PNG
(8-pCP-cGMP | Cyclic GMP analogs | cGMP)
Show SMILES Nc1nc(=O)c2nc(Sc3ccc(Cl)cc3)n([C@@H]3O[C@@H]4COP(O)(=O)O[C@H]4[C@H]3O)c2[nH]1
Show InChI InChI=1S/C16H15ClN5O7PS/c17-6-1-3-7(4-2-6)31-16-19-9-12(20-15(18)21-13(9)24)22(16)14-10(23)11-8(28-14)5-27-30(25,26)29-11/h1-4,8,10-11,14,23H,5H2,(H,25,26)(H3,18,20,21,24)/t8-,10-,11-,14-/m1/s1
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n/an/an/an/a 7.70n/an/an/an/a



Baylor College of Medicine



Assay Description
Kinase activity was determined employing a microfluidic mobility-shift assay on a Caliper DeskTop Profiler (Caliper Life Sciences, PerkinElmer). The ...


ACS Chem Biol 12: 2388-2398 (2017)


Article DOI: 10.1021/acschembio.7b00369
BindingDB Entry DOI: 10.7270/Q2930RB1
More data for this
Ligand-Target Pair
hPKG 1 beta 5-676


(Homo sapiens (Human))
BDBM65501
PNG
(8-pCP-cGMP | Cyclic GMP analogs | cGMP)
Show SMILES Nc1nc(=O)c2nc(Sc3ccc(Cl)cc3)n([C@@H]3O[C@@H]4COP(O)(=O)O[C@H]4[C@H]3O)c2[nH]1
Show InChI InChI=1S/C16H15ClN5O7PS/c17-6-1-3-7(4-2-6)31-16-19-9-12(20-15(18)21-13(9)24)22(16)14-10(23)11-8(28-14)5-27-30(25,26)29-11/h1-4,8,10-11,14,23H,5H2,(H,25,26)(H3,18,20,21,24)/t8-,10-,11-,14-/m1/s1
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Baylor College of Medicine



Assay Description
Kinase activity was determined employing a microfluidic mobility-shift assay on a Caliper DeskTop Profiler (Caliper Life Sciences, PerkinElmer). The ...


ACS Chem Biol 12: 2388-2398 (2017)


Article DOI: 10.1021/acschembio.7b00369
BindingDB Entry DOI: 10.7270/Q2930RB1
More data for this
Ligand-Target Pair
hPKG 1 beta 5-676


(Homo sapiens (Human))
BDBM65501
PNG
(8-pCP-cGMP | Cyclic GMP analogs | cGMP)
Show SMILES Nc1nc(=O)c2nc(Sc3ccc(Cl)cc3)n([C@@H]3O[C@@H]4COP(O)(=O)O[C@H]4[C@H]3O)c2[nH]1
Show InChI InChI=1S/C16H15ClN5O7PS/c17-6-1-3-7(4-2-6)31-16-19-9-12(20-15(18)21-13(9)24)22(16)14-10(23)11-8(28-14)5-27-30(25,26)29-11/h1-4,8,10-11,14,23H,5H2,(H,25,26)(H3,18,20,21,24)/t8-,10-,11-,14-/m1/s1
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n/an/an/an/a 249n/an/an/an/a



Baylor College of Medicine



Assay Description
Kinase activity was determined employing a microfluidic mobility-shift assay on a Caliper DeskTop Profiler (Caliper Life Sciences, PerkinElmer). The ...


ACS Chem Biol 12: 2388-2398 (2017)


Article DOI: 10.1021/acschembio.7b00369
BindingDB Entry DOI: 10.7270/Q2930RB1
More data for this
Ligand-Target Pair
cGMP-dependent protein kinase 2


(Homo sapiens)
BDBM65501
PNG
(8-pCP-cGMP | Cyclic GMP analogs | cGMP)
Show SMILES Nc1nc(=O)c2nc(Sc3ccc(Cl)cc3)n([C@@H]3O[C@@H]4COP(O)(=O)O[C@H]4[C@H]3O)c2[nH]1
Show InChI InChI=1S/C16H15ClN5O7PS/c17-6-1-3-7(4-2-6)31-16-19-9-12(20-15(18)21-13(9)24)22(16)14-10(23)11-8(28-14)5-27-30(25,26)29-11/h1-4,8,10-11,14,23H,5H2,(H,25,26)(H3,18,20,21,24)/t8-,10-,11-,14-/m1/s1
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Baylor College of Medicine



Assay Description
Kinase activity was determined employing a microfluidic mobility-shift assay on a Caliper DeskTop Profiler (Caliper Life Sciences, PerkinElmer). The ...


ACS Chem Biol 12: 2388-2398 (2017)


Article DOI: 10.1021/acschembio.7b00369
BindingDB Entry DOI: 10.7270/Q2930RB1
More data for this
Ligand-Target Pair
cGMP-dependent protein kinase 2


(Homo sapiens)
BDBM65501
PNG
(8-pCP-cGMP | Cyclic GMP analogs | cGMP)
Show SMILES Nc1nc(=O)c2nc(Sc3ccc(Cl)cc3)n([C@@H]3O[C@@H]4COP(O)(=O)O[C@H]4[C@H]3O)c2[nH]1
Show InChI InChI=1S/C16H15ClN5O7PS/c17-6-1-3-7(4-2-6)31-16-19-9-12(20-15(18)21-13(9)24)22(16)14-10(23)11-8(28-14)5-27-30(25,26)29-11/h1-4,8,10-11,14,23H,5H2,(H,25,26)(H3,18,20,21,24)/t8-,10-,11-,14-/m1/s1
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n/an/an/an/a 22n/an/an/an/a



Baylor College of Medicine



Assay Description
Kinase activity was determined employing a microfluidic mobility-shift assay on a Caliper DeskTop Profiler (Caliper Life Sciences, PerkinElmer). The ...


ACS Chem Biol 12: 2388-2398 (2017)


Article DOI: 10.1021/acschembio.7b00369
BindingDB Entry DOI: 10.7270/Q2930RB1
More data for this
Ligand-Target Pair
hPKG II 41−418


(Homo sapiens (Human))
BDBM65501
PNG
(8-pCP-cGMP | Cyclic GMP analogs | cGMP)
Show SMILES Nc1nc(=O)c2nc(Sc3ccc(Cl)cc3)n([C@@H]3O[C@@H]4COP(O)(=O)O[C@H]4[C@H]3O)c2[nH]1
Show InChI InChI=1S/C16H15ClN5O7PS/c17-6-1-3-7(4-2-6)31-16-19-9-12(20-15(18)21-13(9)24)22(16)14-10(23)11-8(28-14)5-27-30(25,26)29-11/h1-4,8,10-11,14,23H,5H2,(H,25,26)(H3,18,20,21,24)/t8-,10-,11-,14-/m1/s1
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n/an/an/an/a 96n/an/an/an/a



Baylor College of Medicine



Assay Description
Kinase activity was determined employing a microfluidic mobility-shift assay on a Caliper DeskTop Profiler (Caliper Life Sciences, PerkinElmer). The ...


ACS Chem Biol 12: 2388-2398 (2017)


Article DOI: 10.1021/acschembio.7b00369
BindingDB Entry DOI: 10.7270/Q2930RB1
More data for this
Ligand-Target Pair
hPKG II 41−418


(Homo sapiens (Human))
BDBM65501
PNG
(8-pCP-cGMP | Cyclic GMP analogs | cGMP)
Show SMILES Nc1nc(=O)c2nc(Sc3ccc(Cl)cc3)n([C@@H]3O[C@@H]4COP(O)(=O)O[C@H]4[C@H]3O)c2[nH]1
Show InChI InChI=1S/C16H15ClN5O7PS/c17-6-1-3-7(4-2-6)31-16-19-9-12(20-15(18)21-13(9)24)22(16)14-10(23)11-8(28-14)5-27-30(25,26)29-11/h1-4,8,10-11,14,23H,5H2,(H,25,26)(H3,18,20,21,24)/t8-,10-,11-,14-/m1/s1
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n/an/an/an/a 5n/an/an/an/a



Baylor College of Medicine



Assay Description
Kinase activity was determined employing a microfluidic mobility-shift assay on a Caliper DeskTop Profiler (Caliper Life Sciences, PerkinElmer). The ...


ACS Chem Biol 12: 2388-2398 (2017)


Article DOI: 10.1021/acschembio.7b00369
BindingDB Entry DOI: 10.7270/Q2930RB1
More data for this
Ligand-Target Pair
hPKG II 41−418 (G232E)


(Homo sapiens (Human))
BDBM65501
PNG
(8-pCP-cGMP | Cyclic GMP analogs | cGMP)
Show SMILES Nc1nc(=O)c2nc(Sc3ccc(Cl)cc3)n([C@@H]3O[C@@H]4COP(O)(=O)O[C@H]4[C@H]3O)c2[nH]1
Show InChI InChI=1S/C16H15ClN5O7PS/c17-6-1-3-7(4-2-6)31-16-19-9-12(20-15(18)21-13(9)24)22(16)14-10(23)11-8(28-14)5-27-30(25,26)29-11/h1-4,8,10-11,14,23H,5H2,(H,25,26)(H3,18,20,21,24)/t8-,10-,11-,14-/m1/s1
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Baylor College of Medicine



Assay Description
Kinase activity was determined employing a microfluidic mobility-shift assay on a Caliper DeskTop Profiler (Caliper Life Sciences, PerkinElmer). The ...


ACS Chem Biol 12: 2388-2398 (2017)


Article DOI: 10.1021/acschembio.7b00369
BindingDB Entry DOI: 10.7270/Q2930RB1
More data for this
Ligand-Target Pair
hPKG II 41−418 (G232E)


(Homo sapiens (Human))
BDBM65501
PNG
(8-pCP-cGMP | Cyclic GMP analogs | cGMP)
Show SMILES Nc1nc(=O)c2nc(Sc3ccc(Cl)cc3)n([C@@H]3O[C@@H]4COP(O)(=O)O[C@H]4[C@H]3O)c2[nH]1
Show InChI InChI=1S/C16H15ClN5O7PS/c17-6-1-3-7(4-2-6)31-16-19-9-12(20-15(18)21-13(9)24)22(16)14-10(23)11-8(28-14)5-27-30(25,26)29-11/h1-4,8,10-11,14,23H,5H2,(H,25,26)(H3,18,20,21,24)/t8-,10-,11-,14-/m1/s1
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n/an/an/an/a 116n/an/an/an/a



Baylor College of Medicine



Assay Description
Kinase activity was determined employing a microfluidic mobility-shift assay on a Caliper DeskTop Profiler (Caliper Life Sciences, PerkinElmer). The ...


ACS Chem Biol 12: 2388-2398 (2017)


Article DOI: 10.1021/acschembio.7b00369
BindingDB Entry DOI: 10.7270/Q2930RB1
More data for this
Ligand-Target Pair
hPKG II 41−418 (G356E)


(Homo sapiens (Human))
BDBM65501
PNG
(8-pCP-cGMP | Cyclic GMP analogs | cGMP)
Show SMILES Nc1nc(=O)c2nc(Sc3ccc(Cl)cc3)n([C@@H]3O[C@@H]4COP(O)(=O)O[C@H]4[C@H]3O)c2[nH]1
Show InChI InChI=1S/C16H15ClN5O7PS/c17-6-1-3-7(4-2-6)31-16-19-9-12(20-15(18)21-13(9)24)22(16)14-10(23)11-8(28-14)5-27-30(25,26)29-11/h1-4,8,10-11,14,23H,5H2,(H,25,26)(H3,18,20,21,24)/t8-,10-,11-,14-/m1/s1
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Baylor College of Medicine



Assay Description
Kinase activity was determined employing a microfluidic mobility-shift assay on a Caliper DeskTop Profiler (Caliper Life Sciences, PerkinElmer). The ...


ACS Chem Biol 12: 2388-2398 (2017)


Article DOI: 10.1021/acschembio.7b00369
BindingDB Entry DOI: 10.7270/Q2930RB1
More data for this
Ligand-Target Pair
hPKG 1 beta 1-351


(Homo sapiens (Human))
BDBM65501
PNG
(8-pCP-cGMP | Cyclic GMP analogs | cGMP)
Show SMILES Nc1nc(=O)c2nc(Sc3ccc(Cl)cc3)n([C@@H]3O[C@@H]4COP(O)(=O)O[C@H]4[C@H]3O)c2[nH]1
Show InChI InChI=1S/C16H15ClN5O7PS/c17-6-1-3-7(4-2-6)31-16-19-9-12(20-15(18)21-13(9)24)22(16)14-10(23)11-8(28-14)5-27-30(25,26)29-11/h1-4,8,10-11,14,23H,5H2,(H,25,26)(H3,18,20,21,24)/t8-,10-,11-,14-/m1/s1
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n/an/an/an/a 212n/an/an/an/a



Baylor College of Medicine



Assay Description
Kinase activity was determined employing a microfluidic mobility-shift assay on a Caliper DeskTop Profiler (Caliper Life Sciences, PerkinElmer). The ...


ACS Chem Biol 12: 2388-2398 (2017)


Article DOI: 10.1021/acschembio.7b00369
BindingDB Entry DOI: 10.7270/Q2930RB1
More data for this
Ligand-Target Pair
hPKG II 41−418 (G356E)


(Homo sapiens (Human))
BDBM65501
PNG
(8-pCP-cGMP | Cyclic GMP analogs | cGMP)
Show SMILES Nc1nc(=O)c2nc(Sc3ccc(Cl)cc3)n([C@@H]3O[C@@H]4COP(O)(=O)O[C@H]4[C@H]3O)c2[nH]1
Show InChI InChI=1S/C16H15ClN5O7PS/c17-6-1-3-7(4-2-6)31-16-19-9-12(20-15(18)21-13(9)24)22(16)14-10(23)11-8(28-14)5-27-30(25,26)29-11/h1-4,8,10-11,14,23H,5H2,(H,25,26)(H3,18,20,21,24)/t8-,10-,11-,14-/m1/s1
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Baylor College of Medicine



Assay Description
Kinase activity was determined employing a microfluidic mobility-shift assay on a Caliper DeskTop Profiler (Caliper Life Sciences, PerkinElmer). The ...


ACS Chem Biol 12: 2388-2398 (2017)


Article DOI: 10.1021/acschembio.7b00369
BindingDB Entry DOI: 10.7270/Q2930RB1
More data for this
Ligand-Target Pair
hPKG 1 beta 1-351 (G182E)


(Homo sapiens (Human))
BDBM65501
PNG
(8-pCP-cGMP | Cyclic GMP analogs | cGMP)
Show SMILES Nc1nc(=O)c2nc(Sc3ccc(Cl)cc3)n([C@@H]3O[C@@H]4COP(O)(=O)O[C@H]4[C@H]3O)c2[nH]1
Show InChI InChI=1S/C16H15ClN5O7PS/c17-6-1-3-7(4-2-6)31-16-19-9-12(20-15(18)21-13(9)24)22(16)14-10(23)11-8(28-14)5-27-30(25,26)29-11/h1-4,8,10-11,14,23H,5H2,(H,25,26)(H3,18,20,21,24)/t8-,10-,11-,14-/m1/s1
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Baylor College of Medicine



Assay Description
Kinase activity was determined employing a microfluidic mobility-shift assay on a Caliper DeskTop Profiler (Caliper Life Sciences, PerkinElmer). The ...


ACS Chem Biol 12: 2388-2398 (2017)


Article DOI: 10.1021/acschembio.7b00369
BindingDB Entry DOI: 10.7270/Q2930RB1
More data for this
Ligand-Target Pair